2,4(1H,3H)-Pyrimidinedione, 5,6-dihydro-1-(alpha-methylbenzyloxy)-
Basic information
- CAS
30204-48-9- Standard SMILES
CC(ON1CCC(=O)NC1=O)c1ccccc1- InChIKey
WDHMRVXXQNVPKL-UHFFFAOYSA-N- Molecular formula
- C12H14N2O3
- Average molar mass
- 234.25 g/mol
- Monoisotopic mass
- 234.10044231
Names & identifiers
- Preferred name
- 2,4(1H,3H)-Pyrimidinedione, 5,6-dihydro-1-(alpha-methylbenzyloxy)-
- IUPAC
- 1-(1-phenylethoxy)-1,3-diazinane-2,4-dione
Names & synonyms
30204-48-92,4(1H,3H)-Pyrimidinedione, 5,6-dihydro-1-(alpha-methylbenzyloxy)-RefChem:1059539BRN 07977055,6-Dihydro-1-(alpha-methylbenzyloxy)-2,4(1H,3H)-pyrimidinedioneDTXSID409525944-Hydroxy-1-(1-phenylethoxy)-5,6-dihydropyrimidin-2(1H)-one
Database identifiers
- CAS
30204-48-9- PubChem CID
- 207571
- DTXSID
DTXSID40952594- Nikkaji
- J86.909K
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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